CID 17298

Encyprate

Structural Information

Molecular Formula
C13H17NO2
SMILES
CCOC(=O)N(CC1=CC=CC=C1)C2CC2
InChI
InChI=1S/C13H17NO2/c1-2-16-13(15)14(12-8-9-12)10-11-6-4-3-5-7-11/h3-7,12H,2,8-10H2,1H3
InChIKey
OGXBVBBMMWSZJO-UHFFFAOYSA-N
Compound name
ethyl N-benzyl-N-cyclopropylcarbamate
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

5
References

342
Patents

219.12593 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.133206 148.8
[M+Na]+ 242.115148 155.9
[M-H]- 218.118654 157.3
[M+NH4]+ 237.159753 162.7
[M+K]+ 258.089088 154.2
[M+H-H2O]+ 202.123190 141.3
[M+HCOO]- 264.124131 173.8
[M+CH3COO]- 278.139781 195.6
[M+Na-2H]- 240.100596 153.8
[M]+ 219.12538142 153.1
[M]- 219.12647858 153.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe