CID 2756110

Fmoc-l-indoline-2-carboxylic acid

Structural Information

Molecular Formula
C24H19NO4
SMILES
C1[C@H](N(C2=CC=CC=C21)C(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)C(=O)O
InChI
InChI=1S/C24H19NO4/c26-23(27)22-13-15-7-1-6-12-21(15)25(22)24(28)29-14-20-18-10-4-2-8-16(18)17-9-3-5-11-19(17)20/h1-12,20,22H,13-14H2,(H,26,27)/t22-/m0/s1
InChIKey
FWYAYXBFHLDIRA-QFIPXVFZSA-N
Compound name
(2S)-1-(9H-fluoren-9-ylmethoxycarbonyl)-2,3-dihydroindole-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

57
Patents

385.1314 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 386.13868 191.3
[M+Na]+ 408.12062 204.1
[M+NH4]+ 403.16522 199.2
[M+K]+ 424.09456 200.5
[M-H]- 384.12412 194.7
[M+Na-2H]- 406.10607 195.2
[M]+ 385.13085 194.0
[M]- 385.13195 194.0
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

patents stripe