CID 2794277

352235-99-5

Structural Information

Molecular Formula
C19H22N2O2
SMILES
C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NCCCCN
InChI
InChI=1S/C19H22N2O2/c20-11-5-6-12-21-19(22)23-13-18-16-9-3-1-7-14(16)15-8-2-4-10-17(15)18/h1-4,7-10,18H,5-6,11-13,20H2,(H,21,22)
InChIKey
GUERCAXBAHLNFO-UHFFFAOYSA-N
Compound name
9H-fluoren-9-ylmethyl N-(4-aminobutyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

129
Patents

310.16812 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.175396 172.9
[M+Na]+ 333.157338 178.6
[M-H]- 309.160844 177.3
[M+NH4]+ 328.201943 190.7
[M+K]+ 349.131278 173.7
[M+H-H2O]+ 293.165380 165.5
[M+HCOO]- 355.166321 195.5
[M+CH3COO]- 369.181971 210.8
[M+Na-2H]- 331.142786 176.9
[M]+ 310.16757142 174.3
[M]- 310.16866858 174.3
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