CID 35906

31755-23-4

Structural Information

Molecular Formula
C18H28N2O2
SMILES
CC1=C(C(=CC=C1)C)NC(=O)OC2CCCN(C2)C(C)(C)C
InChI
InChI=1S/C18H28N2O2/c1-13-8-6-9-14(2)16(13)19-17(21)22-15-10-7-11-20(12-15)18(3,4)5/h6,8-9,15H,7,10-12H2,1-5H3,(H,19,21)
InChIKey
GNWFVFIRKIFSPN-UHFFFAOYSA-N
Compound name
(1-tert-butylpiperidin-3-yl) N-(2,6-dimethylphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

304.2151 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.22238 176.1
[M+Na]+ 327.20432 180.4
[M-H]- 303.20782 180.7
[M+NH4]+ 322.24892 189.7
[M+K]+ 343.17826 177.6
[M+H-H2O]+ 287.21236 168.0
[M+HCOO]- 349.21330 192.6
[M+CH3COO]- 363.22895 208.7
[M+Na-2H]- 325.18977 177.1
[M]+ 304.21455 174.1
[M]- 304.21565 174.1
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.