CID 11758879

Fmoc-gly-cl

Structural Information

Molecular Formula

C₁₇H₁₄ClNO₃

SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NCC(=O)Cl

InChI

InChI=1S/C17H14ClNO3/c18-16(20)9-19-17(21)22-10-15-13-7-3-1-5-11(13)12-6-2-4-8-14(12)15/h1-8,15H,9-10H2,(H,19,21)

InChIKey

HFWFBOCOXPEKBV-UHFFFAOYSA-N

Compound name

9H-fluoren-9-ylmethyl N-(2-chloro-2-oxoethyl)carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 239
Patents: 315.06622 Da
Monoisotopic Mass: 3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	316.07350	171.0
[M+Na]+	338.05544	179.3
[M-H]-	314.05894	176.4
[M+NH4]+	333.10004	189.9
[M+K]+	354.02938	173.9
[M+H-H2O]+	298.06348	165.2
[M+HCOO]-	360.06442	188.8
[M+CH3COO]-	374.08007	206.1
[M+Na-2H]-	336.04089	174.9
[M]+	315.06567	175.9
[M]-	315.06677	175.9

Literature stripe

literature stripe

Patent stripe

patents stripe