CID 2794141

1-phenylethyl n-naphthalen-1-ylcarbamate

Structural Information

Molecular Formula
C19H17NO2
SMILES
CC(C1=CC=CC=C1)OC(=O)NC2=CC=CC3=CC=CC=C32
InChI
InChI=1S/C19H17NO2/c1-14(15-8-3-2-4-9-15)22-19(21)20-18-13-7-11-16-10-5-6-12-17(16)18/h2-14H,1H3,(H,20,21)
InChIKey
ZTZHHYAALZEMIS-UHFFFAOYSA-N
Compound name
1-phenylethyl N-naphthalen-1-ylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

291.12592 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.133196 167.7
[M+Na]+ 314.115138 173.1
[M-H]- 290.118644 174.7
[M+NH4]+ 309.159743 183.1
[M+K]+ 330.089078 169.0
[M+H-H2O]+ 274.123180 159.1
[M+HCOO]- 336.124121 189.7
[M+CH3COO]- 350.139771 204.4
[M+Na-2H]- 312.100586 173.5
[M]+ 291.12537142 167.5
[M]- 291.12646858 167.5
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.