CID 2736485

126705-22-4

Structural Information

Molecular Formula
C19H17NO4
SMILES
C1CC1(C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChI
InChI=1S/C19H17NO4/c21-17(22)19(9-10-19)20-18(23)24-11-16-14-7-3-1-5-12(14)13-6-2-4-8-15(13)16/h1-8,16H,9-11H2,(H,20,23)(H,21,22)
InChIKey
OPPOISJKHBLNPD-UHFFFAOYSA-N
Compound name
1-(9H-fluoren-9-ylmethoxycarbonylamino)cyclopropane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

393
Patents

323.11575 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.12303 170.7
[M+Na]+ 346.10497 179.3
[M-H]- 322.10847 178.3
[M+NH4]+ 341.14957 184.5
[M+K]+ 362.07891 174.5
[M+H-H2O]+ 306.11301 165.1
[M+HCOO]- 368.11395 190.6
[M+CH3COO]- 382.12960 208.6
[M+Na-2H]- 344.09042 175.4
[M]+ 323.11520 175.2
[M]- 323.11630 175.2
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