CID 44700

N-1-naphthyl ethyl urethane

Structural Information

Molecular Formula
C15H17NO2
SMILES
CCN(C1=CC=CC2=CC=CC=C21)C(=O)OCC
InChI
InChI=1S/C15H17NO2/c1-3-16(15(17)18-4-2)14-11-7-9-12-8-5-6-10-13(12)14/h5-11H,3-4H2,1-2H3
InChIKey
WJJMHXJWKUMPKT-UHFFFAOYSA-N
Compound name
ethyl N-ethyl-N-naphthalen-1-ylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

4
Patents

243.12593 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.13321 155.6
[M+Na]+ 266.11515 162.0
[M-H]- 242.11865 161.2
[M+NH4]+ 261.15975 174.4
[M+K]+ 282.08909 160.2
[M+H-H2O]+ 226.12319 148.3
[M+HCOO]- 288.12413 179.2
[M+CH3COO]- 302.13978 199.0
[M+Na-2H]- 264.10060 161.5
[M]+ 243.12538 158.6
[M]- 243.12648 158.6
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.