CID 307520

116373-26-3

Structural Information

Molecular Formula
C16H13NO3
SMILES
C1=CC=C2C(=C1)C=CC=C2NC(=O)OCC3=CC=CO3
InChI
InChI=1S/C16H13NO3/c18-16(20-11-13-7-4-10-19-13)17-15-9-3-6-12-5-1-2-8-14(12)15/h1-10H,11H2,(H,17,18)
InChIKey
JOVRNJDTWQBMEW-UHFFFAOYSA-N
Compound name
furan-2-ylmethyl N-naphthalen-1-ylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

267.08954 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.09682 158.1
[M+Na]+ 290.07876 166.3
[M-H]- 266.08226 166.9
[M+NH4]+ 285.12336 175.5
[M+K]+ 306.05270 163.8
[M+H-H2O]+ 250.08680 150.8
[M+HCOO]- 312.08774 183.8
[M+CH3COO]- 326.10339 171.4
[M+Na-2H]- 288.06421 165.8
[M]+ 267.08899 162.0
[M]- 267.09009 162.0
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.