CID 63310303

1072502-03-4

Structural Information

Molecular Formula
C21H23NO3
SMILES
C1CN(CCC1CO)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChI
InChI=1S/C21H23NO3/c23-13-15-9-11-22(12-10-15)21(24)25-14-20-18-7-3-1-5-16(18)17-6-2-4-8-19(17)20/h1-8,15,20,23H,9-14H2
InChIKey
YYTSXYVXBGQKCP-UHFFFAOYSA-N
Compound name
9H-fluoren-9-ylmethyl 4-(hydroxymethyl)piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

337.1678 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.17508 180.9
[M+Na]+ 360.15702 185.9
[M-H]- 336.16052 185.7
[M+NH4]+ 355.20162 195.8
[M+K]+ 376.13096 180.5
[M+H-H2O]+ 320.16506 172.3
[M+HCOO]- 382.16600 195.6
[M+CH3COO]- 396.18165 189.9
[M+Na-2H]- 358.14247 181.7
[M]+ 337.16725 178.8
[M]- 337.16835 178.8
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