CID 137935432

Tert-butyl n-(cyclohexylmethyl)-n-(2-methylphenyl)carbamate

Structural Information

Molecular Formula
C19H29NO2
SMILES
CC1=CC=CC=C1N(CC2CCCCC2)C(=O)OC(C)(C)C
InChI
InChI=1S/C19H29NO2/c1-15-10-8-9-13-17(15)20(18(21)22-19(2,3)4)14-16-11-6-5-7-12-16/h8-10,13,16H,5-7,11-12,14H2,1-4H3
InChIKey
HYNDSGZWCGPEMP-UHFFFAOYSA-N
Compound name
tert-butyl N-(cyclohexylmethyl)-N-(2-methylphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

303.21982 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.227096 175.6
[M+Na]+ 326.209038 177.7
[M-H]- 302.212544 182.1
[M+NH4]+ 321.253643 190.7
[M+K]+ 342.182978 176.2
[M+H-H2O]+ 286.217080 167.7
[M+HCOO]- 348.218021 193.6
[M+CH3COO]- 362.233671 210.0
[M+Na-2H]- 324.194486 176.6
[M]+ 303.21927142 173.9
[M]- 303.22036858 173.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.